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2-(4-Bromophenyl)-5-[2-(2-naphthylsulfonyl)ethyl]-1,3,4-oxadiazole

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-(4-Bromophenyl)-5-[2-(2-naphthylsulfonyl)ethyl]-1,3,4-oxadiazole
SpectraBase Compound ID 1FOE70Jk3le
InChI InChI=1S/C20H15BrN2O3S/c21-17-8-5-15(6-9-17)20-23-22-19(26-20)11-12-27(24,25)18-10-7-14-3-1-2-4-16(14)13-18/h1-10,13H,11-12H2
InChIKey WIAUIOKEJKFVMN-UHFFFAOYSA-N
Mol Weight 443.32 g/mol
Molecular Formula C20H15BrN2O3S
Exact Mass 441.998677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59ZgbZIjdXO
Name 2-(4-Bromophenyl)-5-[2-(2-naphthylsulfonyl)ethyl]-1,3,4-oxadiazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.998676522 u
Formula C20H15BrN2O3S
InChI InChI=1S/C20H15BrN2O3S/c21-17-8-5-15(6-9-17)20-23-22-19(26-20)11-12-27(24,25)18-10-7-14-3-1-2-4-16(14)13-18/h1-10,13H,11-12H2
InChIKey WIAUIOKEJKFVMN-UHFFFAOYSA-N
Molecular Weight 443.315 g/mol
SMILES C1=CC2=CC=C(S(CCC=3OC(C4=CC=C(C=C4)Br)=NN3)(=O)=O)C=C2C=C1